DGT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| PG | O1G | sing | 1.61Å | 1.58Å | |
| PG | O2G | sing | 1.61Å | 1.59Å | |
| O1G | HO1G | sing | 0.97Å | 0.95Å | |
| O2G | HO2G | sing | 0.97Å | 0.95Å | |
| O3G | PG | doub | 1.48Å | 1.59Å | |
| O3B | PG | sing | 1.61Å | 1.59Å | |
| PB | O3B | sing | 1.61Å | 1.60Å | |
| PB | O1B | sing | 1.61Å | 1.60Å | |
| PB | O3A | sing | 1.61Å | 1.60Å | |
| O1B | HO1B | sing | 0.97Å | 0.95Å | |
| O2B | PB | doub | 1.48Å | 1.58Å | |
| PA | O3A | sing | 1.61Å | 1.61Å | |
| PA | O1A | sing | 1.61Å | 1.59Å | |
| O1A | HO1A | sing | 0.97Å | 0.95Å | |
| O2A | PA | doub | 1.48Å | 1.59Å | |
| O5' | PA | sing | 1.61Å | 1.61Å | |
| O5' | C5' | sing | 1.43Å | 1.42Å | |
| C5' | H5' | sing | 1.09Å | 1.10Å | |
| C5' | H5'A | sing | 1.09Å | 1.10Å | |
| C4' | C5' | sing | 1.53Å | 1.53Å | |
| C4' | H4' | sing | 1.09Å | 1.10Å | |
| O4' | C4' | sing | 1.44Å | 1.43Å | |
| C3' | C4' | sing | 1.55Å | 1.52Å | |
| C3' | O3' | sing | 1.43Å | 1.42Å | |
| C3' | H3' | sing | 1.09Å | 1.10Å | |
| O3' | HO3' | sing | 0.97Å | 0.95Å | |
| C2' | C3' | sing | 1.55Å | 1.52Å | |
| C2' | C1' | sing | 1.54Å | 1.53Å | |
| C2' | H2' | sing | 1.09Å | 1.10Å | |
| C2' | H2'A | sing | 1.09Å | 1.10Å | |
| C1' | O4' | sing | 1.44Å | 1.43Å | |
| C1' | H1' | sing | 1.09Å | 1.10Å | |
| N9 | C1' | sing | 1.46Å | 1.50Å | |
| N9 | C4 | sing | 1.37Å | 1.34Å | Aromatic |
| C8 | N9 | sing | 1.37Å | 1.37Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| N7 | C8 | doub | 1.30Å | 1.38Å | Aromatic |
| N7 | C5 | sing | 1.36Å | 1.36Å | Aromatic |
| C5 | C6 | sing | 1.41Å | 1.50Å | |
| C5 | C4 | doub | 1.40Å | 1.46Å | Aromatic |
| C6 | N1 | sing | 1.35Å | 1.35Å | |
| O6 | C6 | doub | 1.22Å | 1.25Å | |
| N1 | C2 | sing | 1.36Å | 1.35Å | |
| C2 | N3 | doub | 1.31Å | 1.36Å | |
| C2 | N2 | sing | 1.37Å | 1.35Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N2 | HN2A | sing | 0.97Å | 1.00Å | |
| C4 | N3 | sing | 1.34Å | 1.45Å | |
| N1 | H16 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1G | PG | O2G | 117.1° | 109.5° |
| PG | O1G | HO1G | 109.5° | 114.0° |
| O1G | PG | O3G | 109.7° | 109.5° |
| O1G | PG | O3B | 103.9° | 109.4° |
| PG | O2G | HO2G | 109.5° | 114.0° |
| O2G | PG | O3G | 107.1° | 109.5° |
| O2G | PG | O3B | 109.2° | 109.5° |
| O3G | PG | O3B | 109.7° | 109.5° |
| PG | O3B | PB | 123.9° | 134.0° |
| O3B | PB | O1B | 113.2° | 109.5° |
| O3B | PB | O3A | 106.7° | 109.5° |
| O3B | PB | O2B | 103.6° | 109.5° |
| O1B | PB | O3A | 107.4° | 109.5° |
| PB | O1B | HO1B | 109.5° | 114.0° |
| O1B | PB | O2B | 114.4° | 109.4° |
| O3A | PB | O2B | 111.3° | 109.5° |
| PB | O3A | PA | 122.8° | 134.0° |
| O3A | PA | O1A | 107.4° | 109.5° |
| O3A | PA | O2A | 109.1° | 109.4° |
| O3A | PA | O5' | 105.3° | 109.5° |
| PA | O1A | HO1A | 109.5° | 114.0° |
| O1A | PA | O2A | 112.3° | 109.4° |
| O1A | PA | O5' | 112.6° | 109.5° |
| O2A | PA | O5' | 109.8° | 109.5° |
| PA | O5' | C5' | 120.1° | 123.0° |
| O5' | C5' | H5' | 108.5° | 109.5° |
| O5' | C5' | H5'A | 107.8° | 109.4° |
| O5' | C5' | C4' | 112.4° | 109.5° |
| H5' | C5' | H5'A | 111.8° | 109.4° |
| H5' | C5' | C4' | 108.5° | 109.5° |
| H5'A | C5' | C4' | 107.8° | 109.5° |
| C5' | C4' | H4' | 103.2° | 110.5° |
| C5' | C4' | O4' | 112.2° | 110.6° |
| C5' | C4' | C3' | 114.8° | 110.6° |
| H4' | C4' | O4' | 110.8° | 110.6° |
| H4' | C4' | C3' | 107.9° | 110.6° |
| O4' | C4' | C3' | 107.9° | 103.6° |
| C4' | O4' | C1' | 112.0° | 107.0° |
| C4' | C3' | O3' | 108.4° | 110.9° |
| C4' | C3' | H3' | 112.6° | 110.9° |
| C4' | C3' | C2' | 106.4° | 102.1° |
| O3' | C3' | H3' | 108.4° | 110.8° |
| C3' | O3' | HO3' | 109.5° | 114.0° |
| O3' | C3' | C2' | 110.7° | 110.9° |
| H3' | C3' | C2' | 110.4° | 110.9° |
| C3' | C2' | C1' | 106.2° | 104.2° |
| C3' | C2' | H2' | 110.5° | 110.5° |
| C3' | C2' | H2'A | 111.3° | 110.5° |
| C1' | C2' | H2' | 110.6° | 110.6° |
| C1' | C2' | H2'A | 111.3° | 110.4° |
| C2' | C1' | O4' | 107.6° | 107.2° |
| C2' | C1' | H1' | 105.9° | 109.9° |
| C2' | C1' | N9 | 116.4° | 109.9° |
| H2' | C2' | H2'A | 107.0° | 110.5° |
| O4' | C1' | H1' | 113.7° | 109.9° |
| O4' | C1' | N9 | 109.0° | 109.9° |
| H1' | C1' | N9 | 104.4° | 110.0° |
| C1' | N9 | C4 | 124.7° | 126.2° |
| C1' | N9 | C8 | 130.1° | 126.3° |
| C4 | N9 | C8 | 105.2° | 107.5° |
| N9 | C4 | C5 | 110.9° | 106.1° |
| N9 | C4 | N3 | 128.5° | 134.3° |
| N9 | C8 | H8 | 124.3° | 125.1° |
| N9 | C8 | N7 | 111.5° | 109.8° |
| H8 | C8 | N7 | 124.3° | 125.1° |
| C8 | N7 | C5 | 108.0° | 109.3° |
| N7 | C5 | C6 | 141.4° | 134.1° |
| N7 | C5 | C4 | 104.4° | 107.3° |
| C6 | C5 | C4 | 114.2° | 118.6° |
| C5 | C6 | N1 | 120.5° | 118.3° |
| C5 | C6 | O6 | 122.1° | 120.9° |
| C5 | C4 | N3 | 120.5° | 119.6° |
| N1 | C6 | O6 | 117.4° | 120.8° |
| C6 | N1 | C2 | 123.3° | 120.4° |
| C6 | N1 | H16 | 118.4° | 119.8° |
| N1 | C2 | N3 | 122.2° | 121.8° |
| N1 | C2 | N2 | 117.9° | 119.1° |
| C2 | N1 | H16 | 118.4° | 119.8° |
| N3 | C2 | N2 | 119.9° | 119.1° |
| C2 | N3 | C4 | 119.2° | 121.2° |
| C2 | N2 | HN2 | 110.4° | 120.0° |
| C2 | N2 | HN2A | 124.8° | 120.1° |
| HN2 | N2 | HN2A | 124.8° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1G | PG | O2G | O3G | 123.6° | 120.0° |
| O1G | PG | O2G | O3B | 117.7° | 119.9° |
| O1G | PG | O2G | HO2G | 135.4° | 60.0° |
| O1G | PG | O3G | O3B | 113.6° | 119.9° |
| O1G | PG | O3B | PB | 171.1° | 75.0° |
| O2G | PG | O1G | HO1G | 21.6° | 59.9° |
| O2G | PG | O3G | O3B | 118.4° | 120.0° |
| O2G | PG | O3B | PB | 45.4° | 165.0° |
| HO1G | O1G | PG | O3G | 100.6° | 180.0° |
| HO1G | O1G | PG | O3B | 142.1° | 60.1° |
| HO2G | O2G | PG | O3G | 101.0° | 60.0° |
| HO2G | O2G | PG | O3B | 17.7° | 180.0° |
| O3G | PG | O3B | PB | 71.6° | 45.0° |
| PG | O3B | PB | O1B | 38.0° | 74.9° |
| PG | O3B | PB | O3A | 80.0° | 165.0° |
| PG | O3B | PB | O2B | 162.4° | 45.0° |
| O3B | PB | O1B | O3A | 117.6° | 120.1° |
| O3B | PB | O1B | O2B | 118.3° | 120.0° |
| O3B | PB | O3A | O2B | 112.3° | 120.0° |
| O3B | PB | O1B | HO1B | 106.7° | 60.0° |
| O3B | PB | O3A | PA | 75.6° | 160.0° |
| O1B | PB | O3A | O2B | 125.9° | 119.9° |
| O1B | PB | O3A | PA | 162.6° | 79.9° |
| O3A | PB | O1B | HO1B | 135.7° | 60.0° |
| PB | O3A | PA | O1A | 158.0° | 74.9° |
| PB | O3A | PA | O2A | 80.1° | 45.0° |
| PB | O3A | PA | O5' | 37.8° | 165.0° |
| HO1B | O1B | PB | O2B | 11.6° | 180.0° |
| O2B | PB | O3A | PA | 36.7° | 40.0° |
| O3A | PA | O1A | O2A | 120.0° | 120.0° |
| O3A | PA | O1A | O5' | 115.5° | 120.0° |
| O3A | PA | O1A | HO1A | 112.3° | 60.0° |
| O3A | PA | O2A | O5' | 115.0° | 120.0° |
| O3A | PA | O5' | C5' | 88.7° | 175.0° |
| O1A | PA | O2A | O5' | 126.1° | 120.0° |
| O1A | PA | O5' | C5' | 28.0° | 65.0° |
| HO1A | O1A | PA | O2A | 7.7° | 180.0° |
| HO1A | O1A | PA | O5' | 132.2° | 60.0° |
| O2A | PA | O5' | C5' | 153.9° | 55.0° |
| PA | O5' | C5' | H5' | 72.5° | 59.9° |
| PA | O5' | C5' | H5'A | 48.8° | 60.0° |
| PA | O5' | C5' | C4' | 167.5° | 180.0° |
| O5' | C5' | H5' | H5'A | 118.8° | 119.9° |
| O5' | C5' | H5' | C4' | 122.4° | 120.0° |
| O5' | C5' | H5'A | C4' | 121.6° | 120.0° |
| O5' | C5' | C4' | H4' | 167.1° | 54.3° |
| O5' | C5' | C4' | O4' | 73.7° | 68.6° |
| O5' | C5' | C4' | C3' | 50.0° | 177.2° |
| H5' | C5' | H5'A | C4' | 119.2° | 120.0° |
| H5' | C5' | C4' | H4' | 47.1° | 174.3° |
| H5' | C5' | C4' | O4' | 166.3° | 51.4° |
| H5' | C5' | C4' | C3' | 70.0° | 62.8° |
| H5'A | C5' | C4' | H4' | 74.2° | 65.7° |
| H5'A | C5' | C4' | O4' | 45.1° | 171.4° |
| H5'A | C5' | C4' | C3' | 168.7° | 57.2° |
| C5' | C4' | H4' | O4' | 120.2° | 122.9° |
| C5' | C4' | H4' | C3' | 121.9° | 122.9° |
| C5' | C4' | O4' | C3' | 127.4° | 118.6° |
| C5' | C4' | C3' | O3' | 114.5° | 86.2° |
| C5' | C4' | C3' | H3' | 5.4° | 37.3° |
| C5' | C4' | C3' | C2' | 126.4° | 155.5° |
| C5' | C4' | O4' | C1' | 129.3° | 158.5° |
| H4' | C4' | O4' | C3' | 117.9° | 118.6° |
| H4' | C4' | C3' | O3' | 0.1° | 36.6° |
| H4' | C4' | C3' | H3' | 119.8° | 160.1° |
| H4' | C4' | C3' | C2' | 119.2° | 81.7° |
| H4' | C4' | O4' | C1' | 116.0° | 78.6° |
| O4' | C4' | C3' | O3' | 119.6° | 155.2° |
| O4' | C4' | C3' | H3' | 120.5° | 81.3° |
| O4' | C4' | C3' | C2' | 0.5° | 36.9° |
| C4' | O4' | C1' | C2' | 2.5° | 26.4° |
| C4' | O4' | C1' | H1' | 114.5° | 93.0° |
| C4' | O4' | C1' | N9 | 129.6° | 145.8° |
| C4' | C3' | O3' | H3' | 122.5° | 123.6° |
| C4' | C3' | O3' | C2' | 116.3° | 112.8° |
| C4' | C3' | H3' | C2' | 118.7° | 112.7° |
| C4' | C3' | O3' | HO3' | 14.1° | 180.0° |
| C4' | C3' | C2' | C1' | 0.9° | 20.8° |
| C4' | C3' | C2' | H2' | 119.1° | 139.6° |
| C4' | C3' | C2' | H2'A | 122.2° | 97.8° |
| C3' | C4' | O4' | C1' | 1.9° | 40.0° |
| O3' | C3' | H3' | C2' | 121.4° | 123.6° |
| O3' | C3' | C2' | C1' | 116.6° | 139.0° |
| O3' | C3' | C2' | H2' | 123.4° | 102.2° |
| O3' | C3' | C2' | H2'A | 4.6° | 20.4° |
| H3' | C3' | O3' | HO3' | 108.4° | 56.4° |
| H3' | C3' | C2' | C1' | 123.3° | 97.5° |
| H3' | C3' | C2' | H2' | 3.3° | 21.4° |
| H3' | C3' | C2' | H2'A | 115.4° | 144.0° |
| HO3' | O3' | C3' | C2' | 130.4° | 67.2° |
| C3' | C2' | C1' | H2' | 120.0° | 118.8° |
| C3' | C2' | C1' | H2'A | 121.3° | 118.6° |
| C3' | C2' | H2' | H2'A | 121.3° | 122.6° |
| C3' | C2' | C1' | O4' | 2.0° | 2.1° |
| C3' | C2' | C1' | H1' | 119.9° | 117.3° |
| C3' | C2' | C1' | N9 | 124.7° | 121.5° |
| C1' | C2' | H2' | H2'A | 121.4° | 122.6° |
| C2' | C1' | O4' | H1' | 116.9° | 119.4° |
| C2' | C1' | O4' | N9 | 127.1° | 119.4° |
| C2' | C1' | H1' | N9 | 123.4° | 121.1° |
| C2' | C1' | N9 | C4 | 148.0° | 85.0° |
| C2' | C1' | N9 | C8 | 33.5° | 94.7° |
| H2' | C2' | C1' | O4' | 117.9° | 116.7° |
| H2' | C2' | C1' | H1' | 120.1° | 123.9° |
| H2' | C2' | C1' | N9 | 4.7° | 2.7° |
| H2'A | C2' | C1' | O4' | 123.3° | 120.7° |
| H2'A | C2' | C1' | H1' | 1.4° | 1.3° |
| H2'A | C2' | C1' | N9 | 114.1° | 119.9° |
| O4' | C1' | H1' | N9 | 118.7° | 121.1° |
| O4' | C1' | N9 | C4 | 90.2° | 157.2° |
| O4' | C1' | N9 | C8 | 88.3° | 23.1° |
| H1' | C1' | N9 | C4 | 31.7° | 36.1° |
| H1' | C1' | N9 | C8 | 149.8° | 144.2° |
| C1' | N9 | C4 | C8 | 178.8° | 179.8° |
| C1' | N9 | C8 | H8 | 0.6° | 0.0° |
| C1' | N9 | C8 | N7 | 179.4° | 180.0° |
| C1' | N9 | C4 | C5 | 179.4° | 179.9° |
| C1' | N9 | C4 | N3 | 1.3° | 0.7° |
| C4 | N9 | C8 | H8 | 179.3° | 179.8° |
| C4 | N9 | C8 | N7 | 0.6° | 0.2° |
| N9 | C4 | C5 | N7 | 0.4° | 0.3° |
| N9 | C4 | C5 | C6 | 179.6° | 179.8° |
| N9 | C4 | C5 | N3 | 179.3° | 179.3° |
| N9 | C4 | N3 | C2 | 179.2° | 179.6° |
| N9 | C8 | H8 | N7 | 180.0° | 180.0° |
| N9 | C8 | N7 | C5 | 0.4° | 0.0° |
| C8 | N9 | C4 | C5 | 0.6° | 0.4° |
| C8 | N9 | C4 | N3 | 179.8° | 179.5° |
| H8 | C8 | N7 | C5 | 179.5° | 180.0° |
| C8 | N7 | C5 | C6 | 179.9° | 180.0° |
| C8 | N7 | C5 | C4 | 0.0° | 0.2° |
| N7 | C5 | C6 | C4 | 179.9° | 179.8° |
| N7 | C5 | C6 | N1 | 179.7° | 179.9° |
| N7 | C5 | C6 | O6 | 0.2° | 0.0° |
| N7 | C5 | C4 | N3 | 179.7° | 179.6° |
| C5 | C6 | N1 | O6 | 179.9° | 180.0° |
| C5 | C6 | N1 | C2 | 0.2° | 0.0° |
| C6 | C5 | C4 | N3 | 0.3° | 0.5° |
| C5 | C6 | N1 | H16 | 179.8° | 180.0° |
| C4 | C5 | C6 | N1 | 0.1° | 0.3° |
| C4 | C5 | C6 | O6 | 179.9° | 179.7° |
| C5 | C4 | N3 | C2 | 0.1° | 0.5° |
| C6 | N1 | C2 | H16 | 180.0° | 179.9° |
| C6 | N1 | C2 | N3 | 0.4° | 0.0° |
| C6 | N1 | C2 | N2 | 179.7° | 180.0° |
| O6 | C6 | N1 | C2 | 179.7° | 180.0° |
| O6 | C6 | N1 | H16 | 0.2° | 0.1° |
| N1 | C2 | N3 | N2 | 179.9° | 180.0° |
| N1 | C2 | N2 | HN2 | 0.1° | 0.1° |
| N1 | C2 | N2 | HN2A | 179.9° | 180.0° |
| N1 | C2 | N3 | C4 | 0.3° | 0.3° |
| N3 | C2 | N2 | HN2 | 180.0° | 180.0° |
| N3 | C2 | N2 | HN2A | 0.1° | 0.1° |
| N3 | C2 | N1 | H16 | 179.6° | 179.9° |
| C2 | N2 | HN2 | HN2A | 180.0° | 179.9° |
| N2 | C2 | N3 | C4 | 179.8° | 179.7° |
| N2 | C2 | N1 | H16 | 0.3° | 0.0° |
